SCHEMBL24761865

SCHEMBL24761865

CC(C)c1ccc(-c2c3c(c(-c4ccc(C(C)(C)C)cc4)c4nsnc24)CCCCCCCC3)cc1

nearest known ligand 0.44

Predicted protein targets (top 20)

geneUniProtsupporting neighboursconfidence
▸ KDM4E B2RXH2 2/20 0.44
▸ HPGD P15428 2/20 0.44
▸ SLC6A2 P23975 1/20 0.33
▸ MAPT P10636 1/20 0.32
▸ HK1 P19367 1/20 0.32
▸ HKDC1 Q2TB90 1/20 0.32
▸ NPSR1 Q6W5P4 1/20 0.32
▸ KDM4C Q9H3R0 1/20 0.32
▸ TDP1 Q9NUW8 1/20 0.32
▸ TMEM97 Q5BJF2 1/20 0.32
▸ SIGMAR1 Q99720 1/20 0.32
▸ NPC1 O15118 1/20 0.31
▸ RAB9A P51151 1/20 0.31
▸ GRIN2C Q14957 1/20 0.31
▸ KIF11 P52732 1/20 0.31
▸ PTPN5 P54829 1/20 0.31
▸ FLT3 P36888 1/20 0.31
▸ ALDH1A1 P00352 1/20 0.30
▸ TP53 P04637 2/20 0.30
▸ SMN1; SMN2 Q16637 1/20 0.30

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL24760551 1.00 KDM4E (0.44) KDM4EHPGDSLC6A2MAPTHK1
SCHEMBL24760552 0.91 SLC6A2 (0.38) KDM4ESLC6A2MAPTHK1HKDC1
SCHEMBL24761866 0.91 SLC6A2 (0.38) KDM4ESLC6A2MAPTHK1HKDC1
SCHEMBL23385705 0.74 KDM4E (0.38) KDM4EHPGDMAPTNPSR1TDP1
SCHEMBL23385708 0.74 KDM4E (0.38) KDM4EHPGDMAPTNPSR1TDP1
SCHEMBL23385706 0.74 KDM4E (0.38) KDM4EHPGDMAPTNPSR1TDP1
SCHEMBL26017048 0.70 KIF11 (0.52) HPGDMAPTNPC1RAB9AKIF11
SCHEMBL23386030 0.69 HPGD (0.41) KDM4EHPGDMAPTNPC1RAB9A
SCHEMBL548066 0.68 TSHR (0.50) HPGDMAPTNPC1RAB9AKIF11
SCHEMBL23385753 0.68 BRD4 (0.36) KDM4EALDH1A1SMN1; SMN2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
US-20220395821-A1 COVALENT ORGANIC FRAMEWORKS AND APPLICATIONS AS PHOTOCATALYSTS UNIV SOUTH FLORIDA (US) 2022-12-15 — — US disclosed
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